Geometry & MOs

Info

ID:	359082
PubChem CID:	127297327
Reduced:	SN3O3C19H29 (1)
Stoich.:	AB3C3D19E29 (1)
Weight, g/mol:	309.205242
ΔH_f, kcal/mol:	-111.92
Dipole, Da:	3.86
IP(EA), eV:	-8.97(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3CCC3)C

DOS

IR

Vibrations